{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.40534e-10 0.0 0.0 ] "source-value" [ 5.40534 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] "source-value" [ 0.0241155 5.39517 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] "source-value" [ -0.0520891 0.00914509 5.32386 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.496300924304925e-09 2.596529088260621e-10 3.270274157792168e-09 ] [ -3.554787720807859e-10 -1.003798420163871e-09 -3.746284677055737e-10 ] [ 2.441549902859989e-09 2.636590232922429e-09 9.905375247088339e-10 ] [ -2.87684526896514e-09 1.363666835750325e-09 -5.841301560997177e-09 ] [ -6.36096161990016e-11 -9.047267072930689e-11 -6.532936054023591e-10 ] [ -3.732952484741075e-09 1.426670668969002e-09 -8.99479739077611e-10 ] [ 5.371200349764104e-09 -3.912117647756317e-09 2.770009408189941e-09 ] [ -3.280165195160677e-09 -6.801920680359839e-10 7.37882282491778e-10 ] ] "source-value" [ [ 1.5580685 0.1620626 2.0411446 ] [ -0.2218724 -0.6265217 -0.2338247 ] [ 1.5238956 1.6456302 0.6182449 ] [ -1.7955856 0.8511339 -3.6458537 ] [ -0.039702 -0.0564686 -0.4077538 ] [ -2.3299257 0.8904578 -0.5614111 ] [ 3.3524396 -2.4417518 1.7289039 ] [ -2.0473181 -0.4245425 0.4605499 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.75878818328468e-18 "source-value" -35.943529 } }